4-[(5R)-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl]morpholine

C14H23NO — CID 69102035

IUPAC4-[(5R)-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl]morpholine
SMILESC=C(C)[C@@H]1CCC(C)=C(N2CCOCC2)C1
InChIInChI=1S/C14H23NO/c1-11(2)13-5-4-12(3)14(10-13)15-6-8-16-9-7-15/h13H,1,4-10H2,2-3H3/t13-/m1/s1
InChIKeyUOHDKFFCVGNINZ-CYBMUJFWSA-N
MW221.34 g/mol
LogP2.97
Rot. Bonds2

About 4-[(5R)-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl]morpholine

4-[(5R)-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl]morpholine (PubChem CID 69102035) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 4-[(5R)-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl]morpholine.

Molecular Properties

Compound Name4-[(5R)-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl]morpholine
PubChem CID69102035
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name4-[(5R)-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl]morpholine
SMILESC=C(C)[C@@H]1CCC(C)=C(N2CCOCC2)C1
InChIInChI=1S/C14H23NO/c1-11(2)13-5-4-12(3)14(10-13)15-6-8-16-9-7-15/h13H,1,4-10H2,2-3H3/t13-/m1/s1
InChIKeyUOHDKFFCVGNINZ-CYBMUJFWSA-N
XLogP2.97
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[(5R)-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl]morpholine?
The IUPAC name of 4-[(5R)-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl]morpholine (CID 69102035) is 4-[(5R)-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl]morpholine.
What is the SMILES notation for 4-[(5R)-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl]morpholine?
The canonical SMILES for 4-[(5R)-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl]morpholine is C=C(C)[C@@H]1CCC(C)=C(N2CCOCC2)C1.
What is the InChIKey of 4-[(5R)-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl]morpholine?
The InChIKey is UOHDKFFCVGNINZ-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H23NO/c1-11(2)13-5-4-12(3)14(10-13)15-6-8-16-9-7-15/h13H,1,4-10H2,2-3H3/t13-/m1/s1.
What are the key properties of 4-[(5R)-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl]morpholine?
4-[(5R)-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl]morpholine has a molecular weight of 221.34 g/mol, XLogP of 2.97, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5R)-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl]morpholine is sourced from PubChem (CID 69102035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).